REMARK  Name = BDB003614
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.078  -0.262   0.744  0.00  0.00    +0.148 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.249   0.375   0.430  0.00  0.00    +0.035 A 
ATOM      3  C   LIG    1        1.286   1.380  -0.676  0.00  0.00    +0.254 A 
ATOM      4  O   LIG    1        0.281   1.703  -1.299  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1        2.499   1.946  -0.968  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        2.499   2.613  -1.727  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1        3.677   1.667  -0.269  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1        3.640   0.758   0.793  0.00  0.00    -0.001 A 
ATOM      9  C   LIG    1        4.813   0.480   1.500  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        6.008   1.110   1.142  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        6.035   2.016   0.080  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        4.867   2.298  -0.629  0.00  0.00    +0.026 A 
ATOM     13  C   LIG    1        2.370   0.117   1.131  0.00  0.00    +0.020 A 
ENDBRANCH   1   2
BRANCH   1  14
ATOM     14  N   LIG    1       -0.507  -1.230  -0.275  0.00  0.00    -0.294 N 
ATOM     15  C   LIG    1       -1.762  -1.247  -0.878  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -2.007  -2.027  -1.809  0.00  0.00    -0.275 OA
BRANCH  15  17
ATOM     17  C   LIG    1       -2.927  -0.367  -0.401  0.00  0.00    +0.075 C 
ATOM     18  C   LIG    1       -3.330  -0.595   1.062  0.00  0.00    +0.013 C 
ATOM     19  C   LIG    1       -4.611   0.167   1.405  0.00  0.00    +0.001 C 
ATOM     20  C   LIG    1       -4.503   1.647   1.045  0.00  0.00    +0.000 C 
ATOM     21  C   LIG    1       -4.128   1.849  -0.422  0.00  0.00    +0.001 C 
ATOM     22  C   LIG    1       -2.836   1.113  -0.777  0.00  0.00    +0.013 C 
ENDBRANCH  15  17
BRANCH  14  24
ATOM     23  C   LIG    1        0.964  -2.250  -2.041  0.00  0.00    +0.028 C 
ATOM     24  C   LIG    1        0.446  -2.321  -0.602  0.00  0.00    +0.070 C 
ATOM     25  C   LIG    1       -0.103  -3.711  -0.262  0.00  0.00    +0.028 C 
ENDBRANCH  14  24
ENDBRANCH   1  14
TORSDOF 4